SCHEMBL29073263

SCHEMBL29073263

O=[N+]([O-])/C=C/c1c[nH]c2cccc(OCc3ccccc3)c12

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 5/20 0.49
TLR2 O60603 5/20 0.49
MAPT P10636 5/20 0.49
LMNA P02545 4/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
NPSR1 Q6W5P4 4/20 0.49
MAOA P21397 3/20 0.49
MAOB P27338 3/20 0.49
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
HPGD P15428 3/20 0.49
HTT P42858 2/20 0.49
HTR2A P28223 3/20 0.48
CCNB2 O95067 1/20 0.41
CDK1 P06493 1/20 0.41
CDK4 P11802 1/20 0.41
CCNB1 P14635 1/20 0.41
CCND1 P24385 1/20 0.41
CCNB3 Q8WWL7 1/20 0.41
PTGER1 P34995 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30712080 0.84 MAPT (0.46) TLR4TLR2MAPTLMNASMN1; SMN2
SCHEMBL30712096 0.84 MAPT (0.46) TLR4TLR2MAPTLMNASMN1; SMN2
SCHEMBL14961123 0.82 MAPT (0.45) TLR4TLR2MAPTLMNASMN1; SMN2
SCHEMBL2890060 0.82 PTGER4 (0.62) LMNAHTR2APTGER1PTGER4PTGER3
SCHEMBL2890063 0.82 PTGER4 (0.62) LMNAHTR2APTGER1PTGER4PTGER3
SCHEMBL26690472 0.82 MAPT (0.47) TLR4TLR2MAPTLMNASMN1; SMN2
SCHEMBL26612430 0.82 MAPT (0.47) TLR4TLR2MAPTLMNASMN1; SMN2
SCHEMBL1728181 0.82 HTR2A (0.53) MAPTHTR2ACCNB2CDK1CDK4
SCHEMBL1728184 0.82 HTR2A (0.53) MAPTHTR2ACCNB2CDK1CDK4
SCHEMBL14907367 0.81 TLR4 (0.50) TLR4TLR2MAPTLMNASMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260008797-A1 PROCESSES OF PREPARING PSILOCIN AND PSILOCYBIN TERRAN BIOSCIENCES INC (US) 2026-01-08 US disclosed
US-20240317783-A1 PROCESSES OF PREPARING PSILOCIN AND PSILOCYBIN TERRAN BIOSCIENCES INC (US) 2024-09-26 US disclosed
CN-116782896-A Nitrifying galectin derivatives and their use for modulating 5-HT2A receptors and treating psychotic disorders 恩维瑞克生物科学加拿大公司 2023-09-19 CN disclosed
EP-4208446-A1 NITRATED PSILOCYBIN DERIVATIVES AND USE THEREOF FOR MODULATING 5-HT2A RECEPTOR AND FOR TREATING A PSYCHIATRIC DISORDER Enveric Biosciences Canada Inc. (CA) 2023-07-12 EP disclosed
WO-2022047583-A1 NITRATED PSILOCYBIN DERIVATIVES AND USE THEREOF FOR MODULATING 5-HT2A RECEPTOR AND FOR TREATING A PSYCHIATRIC DISORDER MAGICMED INDUSTRIES INC. (CA) 2022-03-10 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240317783-A1 PROCESSES OF PREPARING PSILOCIN AND PSILOCYBIN PNMT, NISCH, HMBS TLR4 4188/4885TLR2 4711/4885MAPT 1304/4885
US-20260008797-A1 PROCESSES OF PREPARING PSILOCIN AND PSILOCYBIN DBH, HTR2C, HTR1B TLR4 1450/4885TLR2 1085/4885MAPT 872/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.